SCHEMBL935470

SCHEMBL935470

C=C(C(=O)O)C(CC)NCCCC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.42
NOD1 Q9Y239 2/20 0.37
BCHE P06276 3/20 0.35
CA2 P00918 3/20 0.34
EPHX1 P07099 2/20 0.34
MAPK1 P28482 2/20 0.34
CA1 P00915 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CASP2 P42575 1/20 0.32
ACHE P22303 1/20 0.32
MMP2 P08253 1/20 0.32
MEN1 O00255 1/20 0.32
FAAH O00519 1/20 0.32
KMT2A Q03164 1/20 0.32
HAO1 Q9UJM8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22804574 0.84 ALOX15 (0.37) ALOX15NOD1BCHECA2EPHX1
SCHEMBL6364480 0.80 TGFBR1 (0.31)
SCHEMBL2064795 0.79 ALOX15 (0.44) ALOX15BCHEEPHX1MAPK1KDM4E
Ammonia Solution, Strong SCHEMBL2495442 0.79
SCHEMBL22043557 0.76 EPHX1 (0.34) ALOX15BCHEEPHX1
SCHEMBL5309803 0.75 NOD1 (0.49) NOD1CA2EPHX1MAPK1
SCHEMBL10782171 0.74 FAAH (0.33) ALOX15FAAH
SCHEMBL1070441 0.74 EPHX1 (0.44) ALOX15NOD1EPHX1CASP2HAO1
SCHEMBL6364868 0.74 TGFBR1 (0.31)
SCHEMBL25305503 0.73 NOD1 (0.51) NOD1EPHX1CASP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1207843-A2 COSMETIC AND/OR PHARMACEUTICAL PREPARATIONS WITH POLYMERS CONTAINING POLYSILOXANES AND THE USES THEREOF BASF AKTIENGESELLSCHAFT (DE) 2002-05-29 EP claimed
WO-2001013884-A2 COSMETIC AND/OR PHARMACEUTICAL PREPARATIONS WITH POLYMERS CONTAINING POLYSILOXANES AND THE USES THEREOF BASF AKTIENGESELLSCHAFT (DE) 2001-03-01 WO claimed
WO-2023248020-A1 BLOCK COPOLYMERS GRAFTED TO POROUS POLYMERIC SUBSTRATE 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-12-28 WO disclosed
EP-2855010-A1 GRAFT COPOLYMER FUNCTIONALIZED ARTICLE 3M Innovative Properties Company (US) 2015-04-08 EP disclosed
EP-2691772-A1 LIGAND FUNCTIONAL SUBSTRATES 3M Innovative Properties Company (US) 2014-02-05 EP disclosed
WO-2013184366-A1 GRAFT COPOLYMER FUNCTIONALIZED ARTICLE 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-12-12 WO disclosed
WO-2012134636-A1 LIGAND FUNCTIONAL SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-10-04 WO disclosed
EP-1915124-B1 POLYESTER ACRYLATE-BASED FIXATIVE POLYMERS BASF SE (DE) 2012-04-25 EP disclosed
EP-2398576-A1 HYDROPHILIC POROUS SUBSTRATES 3M Innovative Properties Company (US) 2011-12-28 EP disclosed
EP-2313183-A1 LIGAND FUNCTIONALIZED SUBSTRATES 3M Innovative Properties Company (US) 2011-04-27 EP disclosed
EP-2294118-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES 3M Innovative Properties Company (US) 2011-03-16 EP disclosed
EP-1709093-A1 ACRYLATE POLYMERS BASED ON TERT.-BUTYL ACRYLATE WHICH ARE TO BE USED IN SPRAY FORMULATIONS BASF AKTIENGESELLSCHAFT (DE) 2006-10-11 EP disclosed
WO-2006045509-A1 COSMETIC PREPARATIONS CONTAINING COPOLYMERS OF ETHYL METHACRYLATE AND AT LEAST ONE MONOETHYLENICALLY UNSATURATED CARBOXYLIC ACID BASF AKTIENGESELLSCHAFT (DE) 2006-05-04 WO disclosed
EP-1642561-A1 Cosmetic composition containing sulfonated polymers with sulfone groups BASF AKTIENGESELLSCHAFT (DE) 2006-04-05 EP disclosed
WO-2005115618-A1 MACROPOROUS ION EXCHANGE RESINS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-12-08 WO disclosed
WO-2005068520-A1 ACRYLATE POLYMERS BASED ON TERT.-BUTYL ACRYLATE WHICH ARE TO BE USED IN SPRAY FORMULATIONS BASF AKTIENGESELLSCHAFT (DE) 2005-07-28 WO disclosed
EP-1259349-A2 THERMOPLASTIC COMPOSITE MATERIAL Henkel Dorus GmbH & Co. KG (DE) 2002-11-27 EP disclosed
EP-1207843-A2 COSMETIC AND/OR PHARMACEUTICAL PREPARATIONS WITH POLYMERS CONTAINING POLYSILOXANES AND THE USES THEREOF BASF AKTIENGESELLSCHAFT (DE) 2002-05-29 EP disclosed
WO-2001013884-A2 COSMETIC AND/OR PHARMACEUTICAL PREPARATIONS WITH POLYMERS CONTAINING POLYSILOXANES AND THE USES THEREOF BASF AKTIENGESELLSCHAFT (DE) 2001-03-01 WO disclosed
WO-2000067937-A2 THERMOPLASTIC COMPOSITE MATERIAL HENKEL DORUS GMBH & CO. KG (DE) 2000-11-16 WO disclosed